Formic Acid

Formic Acid

SCHEMBL1764985

NCCCOc1cccc(-c2cc(C(=O)N3CNC(=O)C3)nn2-c2cccc(Cl)c2)c1.O=CO

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCKAR P32238 1/20 0.46
PTGS2 P35354 5/20 0.41
PTGS1 P23219 2/20 0.41
SLC5A1 P13866 10/20 0.40
PPP1CA P62136 1/20 0.38
SLC16A3 O15427 1/20 0.38
SLC16A1 P53985 1/20 0.38
MCTS1 Q9ULC4 1/20 0.38
MGLL Q99685 1/20 0.37
FABP3 P05413 1/20 0.37
FABP4 P15090 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12597357 0.97 CCKAR (0.48) CCKARPTGS2PTGS1SLC5A1PPP1CA
Formic Acid SCHEMBL1765477 0.91 CCKAR (0.46) CCKARPTGS2PTGS1SLC5A1SLC16A3
Formic Acid SCHEMBL1765040 0.90 CCKAR (0.46) CCKARSLC5A1SLC16A3SLC16A1MCTS1
SCHEMBL1765026 0.90 CCKAR (0.49) CCKARPTGS2PTGS1SLC5A1PPP1CA
Formic Acid SCHEMBL1765274 0.90 CCKAR (0.45) CCKARSLC5A1
Formic Acid SCHEMBL1765453 0.90 CCKAR (0.45) CCKAR
Formic Acid SCHEMBL1765337 0.90 CCKAR (0.45) CCKARPTGS2PTGS1SLC5A1
SCHEMBL1765285 0.90 CCKAR (0.50) CCKARPTGS2PTGS1SLC5A1PPP1CA
Formic Acid SCHEMBL1765265 0.89 CCKAR (0.46) CCKARPTGS2PTGS1SLC5A1SLC16A3
Formic Acid SCHEMBL1765088 0.88 CCKAR (0.46) CCKARPTGS2PTGS1SLC5A1MGLL

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8399682-B2 Substituted (pyrazolylcarbonyl)imidazolidinones and their use AICURIS GMBH & CO. KG (DE) 2013-03-19 US disclosed
US-20110124618-A1 SUBSTITUTED (PYRAZOLYLCARBONYL)IMIDAZOLIDINONES AND THEIR USE AICURIS GMBH & CO. KG (DE) 2011-05-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110124618-A1 SUBSTITUTED (PYRAZOLYLCARBONYL)IMIDAZOLIDINONES AND THEIR USE TPMT, PAICS, THPO CCKAR 4827/4885PTGS2 3497/4885PTGS1 2773/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.